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N-[4-[(2,3-Dimethoxybenzoyl)(phenylmethyl)amino]butyl]-N-[3-[(2,3-dimethoxybenzoyl)-phenylmethyl)amino]propyl]-2,3-dimethoxy-benzamide

View entire compound with spectra: 2 MS (GC)

N-[4-[(2,3-Dimethoxybenzoyl)(phenylmethyl)amino]butyl]-N-[3-[(2,3-dimethoxybenzoyl)-phenylmethyl)amino]propyl]-2,3-dimethoxy-benzamide
SpectraBase Compound ID 7Tbb4jeXiNw
InChI InChI=1S/C48H55N3O9/c1-55-40-26-15-23-37(43(40)58-4)46(52)49(31-18-32-51(34-36-21-11-8-12-22-36)48(54)39-25-17-28-42(57-3)45(39)60-6)29-13-14-30-50(33-35-19-9-7-10-20-35)47(53)38-24-16-27-41(56-2)44(38)59-5/h7-12,15-17,19-28H,13-14,18,29-34H2,1-6H3
InChIKey LZXWLQRZBAFQCC-UHFFFAOYSA-N
Mol Weight 818.0 g/mol
Molecular Formula C48H55N3O9
Exact Mass 817.39383 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6InxCMSyxV
Name N-[4-[(2,3-Dimethoxybenzoyl)(phenylmethyl)amino]butyl]-N-[3-[(2,3-dimethoxybenzoyl)-phenylmethyl)amino]propyl]-2,3-dimethoxy-benzamide
Alternate Name(s) N-benzyl-N-[3-(N-{4-[N-benzyl-1-(2,3-dimethoxyphenyl)formamido]butyl}-1-(2,3-dimethoxyphenyl)formamido)propyl]-2,3-dimethoxybenzamide
CAS Registry Number 79664-31-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H55N3O9
InChI InChI=1S/C48H55N3O9/c1-55-40-26-15-23-37(43(40)58-4)46(52)49(31-18-32-51(34-36-21-11-8-12-22-36)48(54)39-25-17-28-42(57-3)45(39)60-6)29-13-14-30-50(33-35-19-9-7-10-20-35)47(53)38-24-16-27-41(56-2)44(38)59-5/h7-12,15-17,19-28H,13-14,18,29-34H2,1-6H3
InChIKey LZXWLQRZBAFQCC-UHFFFAOYSA-N
Molecular Weight 817.980 g/mol
SMILES c1(C(N(Cc2ccccc2)CCCCN(C(c2c(c(OC)ccc2)OC)=O)CCCN(C(c2c(c(OC)ccc2)OC)=O)Cc2ccccc2)=O)c(c(OC)ccc1)OC
SPLASH splash10-014i-0900002500-de50b1ed34547ee6d361
Source of Spectrum J-46-5236-0
Wiley ID 1417398